4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

C19H24N6 — CID 135336108

IUPAC4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
SMILESCc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1CCC1CCCC1
InChIInChI=1S/C19H24N6/c1-12-22-16-7-6-15(14-10-17(20)24-18(21)11-14)23-19(16)25(12)9-8-13-4-2-3-5-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H4,20,21,24)
InChIKeyZQZDTGBMYWNJHH-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.55
Rot. Bonds4

About 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine

4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine (PubChem CID 135336108) has the molecular formula C19H24N6 and a molecular weight of 336.44 g/mol. Its IUPAC name is 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine.

Molecular Properties

Compound Name4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
PubChem CID135336108
Molecular FormulaC19H24N6
Molecular Weight336.44 g/mol
Exact Mass336.21
IUPAC Name4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
SMILESCc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1CCC1CCCC1
InChIInChI=1S/C19H24N6/c1-12-22-16-7-6-15(14-10-17(20)24-18(21)11-14)23-19(16)25(12)9-8-13-4-2-3-5-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H4,20,21,24)
InChIKeyZQZDTGBMYWNJHH-UHFFFAOYSA-N
XLogP3.55
TPSA95.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[3-(2-cyclopropylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335920
4-[3-[(2,2-dimethylcyclopropyl)methyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335906
4-[2-methyl-3-[2-(2-methylphenyl)ethyl]imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135283877
4-[2-methyl-3-(2-thiophen-3-ylethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335931
4-[3-[2-(3-methoxyphenoxy)ethyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335997
4-[2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335883
4-[3-[2-[(6-bromo-2-pyridinyl)oxy]ethyl]-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335953
4-[[5-(2,6-diamino-4-pyridinyl)-2-methylimidazo[4,5-b]pyridin-3-yl]methyl]benzonitrile
CID 135335878
4-[2-methyl-3-[(2R)-2-(N-methylanilino)propyl]imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135336016
4-[2-methyl-3-(2-phenoxypropyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335804
6-N-benzyl-4-(3-butyl-2-methylimidazo[4,5-b]pyridin-5-yl)pyridine-2,6-diamine
CID 135335944
4-[2-methyl-3-[(2R)-2-pyridin-2-yloxypropyl]imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135336092

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine?
The IUPAC name of 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine (CID 135336108) is 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine.
What is the SMILES notation for 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine?
The canonical SMILES for 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine is Cc1nc2ccc(-c3cc(N)nc(N)c3)nc2n1CCC1CCCC1.
What is the InChIKey of 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine?
The InChIKey is ZQZDTGBMYWNJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6/c1-12-22-16-7-6-15(14-10-17(20)24-18(21)11-14)23-19(16)25(12)9-8-13-4-2-3-5-13/h6-7,10-11,13H,2-5,8-9H2,1H3,(H4,20,21,24).
What are the key properties of 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine?
4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine has a molecular weight of 336.44 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-cyclopentylethyl)-2-methylimidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine is sourced from PubChem (CID 135336108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).